Geometry & MOs

Info

ID:	380989
PubChem CID:	134971606
Reduced:	NC16H17 (1)
Stoich.:	AB16C17 (1)
Weight, g/mol:	185.120449
ΔH_f, kcal/mol:	136.35
Dipole, Da:	2.9
IP(EA), eV:	-8.45(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethenyl-4-methyl-3,4-dihydro-2H-2-benzazepine

Drug info:

PubChemData

Smile

CN(C)/C(=C/C(=C)[C-]1C=CC=C1)/[C-]2C=CC=C2

DOS

IR

Vibrations